›› 2013, Vol. 32 ›› Issue (1): 5-5.
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Abstract: By comparing the differences between the Roothaan-Hartree-Fock function, configuration interaction wave function and Hylleraas-type wave function of Helium ground state, we present intuitive figures to show the reason why Hylleraas-type wave function is more accurate than the others is that it reflects the Coulomb correlation between electrons correctly. A careful analysis of Hylleraas function indicates that Coulomb correlation tends to make the two electrons on the opposite side of nucleus; a simple model of Helium is proposed accordingly which can produce the ground state energy agreement with the experiment.
Key words: Helium, Hylleraas-type wave function, Coulomb correlation, Coulomb hole
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https://dxwl.bnu.edu.cn/EN/Y2013/V32/I1/5
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